Tunable thermal properties in yttrium silicates switched by anharmonicity of low-frequency phonons
文献类型:期刊论文
作者 | Luo, Yixiu1; Sun, Luchao; Wang, Jiemin; Tian, Zhilin2; Nian, Hongqiang3; Wang, Jingyang |
刊名 | JOURNAL OF THE EUROPEAN CERAMIC SOCIETY
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出版日期 | 2018 |
卷号 | 38期号:4页码:2043 |
关键词 | Rare-earth silicates E/TBC Thermal property Phonon anharmonicity Density functional theory |
ISSN号 | 0955-2219 |
DOI | 10.1016/j.jeurceramsoc.2017.11.010 |
英文摘要 | Coordinated modulation of thermal resistance and thermal expansion compatibility has become a chief concern in designing reliable environmental/thermal barrier coating candidates for Si-based ceramics. This study reports phonon behaviors and thermal properties of prototypical silicates X-2-Y2SiO5 and gamma-Y2Si2O7. The nature of an-harmonicity for low-frequency phonons is analyzed, and the finding is discussed with respect to specific crystal structures and interatomic force constants. Low lattice thermal conductivities (KJ basically derive from the giant phonon anharmonicity enhanced by interactions between low-frequency optic and acoustic phonons. gamma-Y2Si2O7 is predicted with considerably lower thermal expansion coefficient (av) than Y2SiO5. The mechanism is disclosed as an effect of the extensive number of low-frequency phonons with negative Griineisen constants (contributing to negative thermal expansion) in gamma-Y2Si2O7, together with its higher elastic stiffness against internal thermal pressure at elevated temperature. A guideline for simultaneously approaching low CL and low av is proposed for searching promising E/TBC candidates. |
学科主题 | Materials Science, Ceramics |
WOS记录号 | WOS:000424716700129 |
出版者 | ELSEVIER SCI LTD |
资助机构 | This work was supported by the National Key R&D Program of China under Grant No. 2017YFB0703201 and Natural Science Foundation of China under Grant Nos. 51372252 and 51772302. ; This work was supported by the National Key R&D Program of China under Grant No. 2017YFB0703201 and Natural Science Foundation of China under Grant Nos. 51372252 and 51772302. |
源URL | [http://ir.sic.ac.cn/handle/331005/25069] ![]() |
专题 | 中国科学院上海硅酸盐研究所 |
作者单位 | 1.Chinese Acad Sci, Inst Met Res, High Performance Ceram Div, Shenyang Natl Lab Mat Sci, Shenyang 110016, Liaoning, Peoples R China 2.Univ Sci & Technol China, Sch Mat Sci & Engn, Hefei, Anhui, Peoples R China 3.Chinese Univ Hong Kong, Dept Elect Engn, Hong Kong, Hong Kong, Peoples R China 4.Chinese Acad Sci, Shanghai Inst Ceram, Shanghai, Peoples R China |
推荐引用方式 GB/T 7714 | Luo, Yixiu,Sun, Luchao,Wang, Jiemin,et al. Tunable thermal properties in yttrium silicates switched by anharmonicity of low-frequency phonons[J]. JOURNAL OF THE EUROPEAN CERAMIC SOCIETY,2018,38(4):2043, 2052. |
APA | Luo, Yixiu,Sun, Luchao,Wang, Jiemin,Tian, Zhilin,Nian, Hongqiang,&Wang, Jingyang.(2018).Tunable thermal properties in yttrium silicates switched by anharmonicity of low-frequency phonons.JOURNAL OF THE EUROPEAN CERAMIC SOCIETY,38(4),2043. |
MLA | Luo, Yixiu,et al."Tunable thermal properties in yttrium silicates switched by anharmonicity of low-frequency phonons".JOURNAL OF THE EUROPEAN CERAMIC SOCIETY 38.4(2018):2043. |
入库方式: OAI收割
来源:上海硅酸盐研究所
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